3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride

C19H26ClN3O2 — CID 154901497

IUPAC3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride
SMILESCl.O=C(CCc1c[nH]c2ccccc12)NC1COC2(CCNCC2)C1
InChIInChI=1S/C19H25N3O2.ClH/c23-18(6-5-14-12-21-17-4-2-1-3-16(14)17)22-15-11-19(24-13-15)7-9-20-10-8-19;/h1-4,12,15,20-21H,5-11,13H2,(H,22,23);1H
InChIKeyDMAKCPKJNHWABT-UHFFFAOYSA-N
MW363.89 g/mol
LogP2.55
Rot. Bonds4

About 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride

3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride (PubChem CID 154901497) has the molecular formula C19H26ClN3O2 and a molecular weight of 363.89 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride
PubChem CID154901497
Molecular FormulaC19H26ClN3O2
Molecular Weight363.89 g/mol
Exact Mass363.17
IUPAC Name3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride
SMILESCl.O=C(CCc1c[nH]c2ccccc12)NC1COC2(CCNCC2)C1
InChIInChI=1S/C19H25N3O2.ClH/c23-18(6-5-14-12-21-17-4-2-1-3-16(14)17)22-15-11-19(24-13-15)7-9-20-10-8-19;/h1-4,12,15,20-21H,5-11,13H2,(H,22,23);1H
InChIKeyDMAKCPKJNHWABT-UHFFFAOYSA-N
XLogP2.55
TPSA66.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.89
LogP ≤ 52.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride?
The IUPAC name of 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride (CID 154901497) is 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride?
The canonical SMILES for 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride is Cl.O=C(CCc1c[nH]c2ccccc12)NC1COC2(CCNCC2)C1.
What is the InChIKey of 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride?
The InChIKey is DMAKCPKJNHWABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2.ClH/c23-18(6-5-14-12-21-17-4-2-1-3-16(14)17)22-15-11-19(24-13-15)7-9-20-10-8-19;/h1-4,12,15,20-21H,5-11,13H2,(H,22,23);1H.
What are the key properties of 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride?
3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride has a molecular weight of 363.89 g/mol, XLogP of 2.55, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propanamide;hydrochloride is sourced from PubChem (CID 154901497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).